2,2,3,4,4,4-Hexafluorobutyric Acid - CAS 379-90-8

Catalog:	BB023482
Product Name:	2,2,3,4,4,4-Hexafluorobutyric Acid
CAS:	379-90-8
Synonyms:	2,2,3,4,4,4-hexafluorobutanoic acid; 2,2,3,4,4,4-hexafluorobutanoic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2,2,3,4,4,4-hexafluorobutanoic acid
Description:	2,2,3,4,4,4-Hexafluorobutyric Acid (CAS# 379-90-8) is a useful research chemical.
Molecular Weight:	196.05
Molecular Formula:	C4H2F6O2
Canonical SMILES:	C(C(C(=O)O)(F)F)(C(F)(F)F)F
InChI:	InChI=1S/C4H2F6O2/c5-1(4(8,9)10)3(6,7)2(11)12/h1H,(H,11,12)
InChI Key:	AZLUIEGTKBIKSG-UHFFFAOYSA-N
Boiling Point:	130.9 °C at 760 mmHg
Density:	1.602 g/cm³
MDL:	MFCD16621311
LogP:	1.60670

Publication Number	Title	Priority Date
CN-101774902-A	Preparation method of polyfluoro aliphatic carboxylic acid	20100113
CN-101774902-B	Preparation method of polyfluoro aliphatic carboxylic acid	20100113
AU-2811501-A	Amidine compounds and their use as pesticides	20000328
EP-1138668-A2	Amidine compounds and their use as pesticides	20000328
JP-2001342170-A	Amidine compounds and uses thereof	20000328

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Related Functional Groups

Carbonyl Compounds

[1427004-19-0]
DBCO-PEG4-NHS ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[17746-05-3]
Undecanoyl chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	185
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	195.99589827
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	8
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	195.99589827
Rotatable Bond Count:	2
Topological Polar Surface Area:	37.3 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	2